4-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-2-oxidanyl-benzoic acid Openeye Name: 4-[2-(2-benzyloxy-5-bromo-phenyl)ethyl]-2-hydroxy-benzoic acid CAS Name: 4-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl]-2-hydroxybenzoic acid IUPAC Name: 4-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl]-2-hydroxybenzoic acid Traditional Name: 4-[2-(2-benzoxy-5-bromo-phenyl)ethyl]-2-hydroxy-benzoic acid Formula: C22H19BrO4 MolecularWeight: 427.28786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CCC3=CC(=C(C=C3)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CCC3=CC(=C(C=C3)C(=O)O)O

InChI

InChI=1S/C22H19BrO4/c23-18-9-11-21(27-14-16-4-2-1-3-5-16)17(13-18)8-6-15-7-10-19(22(25)26)20(24)12-15/h1-5,7,9-13,24H,6,8,14H2,(H,25,26)